SCHEMBL3914980

SCHEMBL3914980

COC(=O)c1cc(Br)c(Oc2ccc([N+](=O)[O-])cc2)c(Br)c1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 5/20 0.52
MAPT P10636 4/20 0.52
MEN1 O00255 5/20 0.50
KMT2A Q03164 5/20 0.50
NPSR1 Q6W5P4 2/20 0.47
NPC1 O15118 1/20 0.47
MAPK1 P28482 1/20 0.47
RAB9A P51151 1/20 0.47
MYOC Q99972 1/20 0.47
KDM4E B2RXH2 2/20 0.46
SRD5A2 P31213 1/20 0.46
HPGD P15428 2/20 0.45
GAA P10253 1/20 0.45
LMNA P02545 1/20 0.45
ALDH1A1 P00352 1/20 0.44
HTT P42858 3/20 0.43
FFAR1 O14842 1/20 0.43
USP10 Q14694 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3133551 0.85 MEN1 (0.68) POLBMAPTMEN1KMT2ANPSR1
SCHEMBL26936962 0.84 HTT (0.58) POLBMAPTMEN1KMT2ANPSR1
SCHEMBL5000810 0.83 MEN1 (0.66) POLBMAPTMEN1KMT2ANPSR1
SCHEMBL5695804 0.83 MEN1 (0.70) POLBMAPTMEN1KMT2ANPSR1
SCHEMBL3140991 0.83 PTGS1 (0.53) POLBMAPTMEN1KMT2AMAPK1
SCHEMBL3130752 0.82 GAA (0.53) MAPTMEN1KMT2AMAPK1RAB9A
SCHEMBL31504041 0.81 POLB (0.69) POLBMAPTMEN1KMT2ANPSR1
SCHEMBL3914754 0.80 USP2 (0.44) POLBMAPTMAPK1KDM4EHPGD
SCHEMBL3138142 0.80 HTT (0.53) POLBMAPTMEN1KMT2ANPSR1
SCHEMBL3137474 0.80 MEN1 (0.49) POLBMAPTMEN1KMT2ANPSR1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090233979-A1 Indole Derivatives and Their Use as Thyroid Receptor Ligands KARO BIO AB (SE) 2009-09-17 US disclosed
EP-2035377-A1 INDOLE DERIVATIVES AND THEIR USE AS THYROID RECEPTOR LIGANDS KARO BIO AB (SE) 2009-03-18 EP disclosed
WO-2007134864-A1 INDOLE DERIVATIVES AND THEIR USE AS THYROID RECEPTOR LIGANDS KARO BIO AB (SE) 2007-11-29 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090233979-A1 Indole Derivatives and Their Use as Thyroid Receptor Ligands TSHR, TRHR, THRA POLB 4685/4885MAPT 3535/4885MEN1 855/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.